1-[ethyl(pyridazin-3-yl)amino]propan-2-ol

C9H15N3O — CID 71402924

IUPAC1-[ethyl(pyridazin-3-yl)amino]propan-2-ol
SMILESCCN(CC(C)O)c1cccnn1
InChIInChI=1S/C9H15N3O/c1-3-12(7-8(2)13)9-5-4-6-10-11-9/h4-6,8,13H,3,7H2,1-2H3
InChIKeyDVMNMKPINBGDIF-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.68
Rot. Bonds4

About 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol

1-[ethyl(pyridazin-3-yl)amino]propan-2-ol (PubChem CID 71402924) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[ethyl(pyridazin-3-yl)amino]propan-2-ol
PubChem CID71402924
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name1-[ethyl(pyridazin-3-yl)amino]propan-2-ol
SMILESCCN(CC(C)O)c1cccnn1
InChIInChI=1S/C9H15N3O/c1-3-12(7-8(2)13)9-5-4-6-10-11-9/h4-6,8,13H,3,7H2,1-2H3
InChIKeyDVMNMKPINBGDIF-UHFFFAOYSA-N
XLogP0.68
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Pildralazine
CID 68829
1-(3-Pyridazinyl)-4-piperidinol
CID 62482251
Isf 2405
CID 129853
1-((6-Chloropyridazin-3-yl)(methyl)amino)propan-2-ol
CID 12237595
3-chloro-6-[N-(2-hydroxypropyl)ethylamino]pyridazine
CID 12237596
4-(Pyridazin-3-yl)morpholine
CID 21647829
3-[Bis-(2-hydroxyethyl)amino] pyridazine
CID 53868471
1,1,1-Trifluoro-3-[methyl-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]amino]propan-2-ol
CID 86792566
(2S)-1,1,1-trifluoro-3-[methyl-[[(2S)-1-pyridazin-3-ylpyrrolidin-2-yl]methyl]amino]propan-2-ol
CID 97881386
(2R)-1,1,1-trifluoro-3-[methyl-[[(2S)-1-pyridazin-3-ylpyrrolidin-2-yl]methyl]amino]propan-2-ol
CID 99855156
1,1,1-Trifluoro-3-(pyridazin-3-ylamino)propan-2-ol
CID 103702578
1,1-Difluoro-3-(pyridazin-3-ylamino)propan-2-ol
CID 103731306

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol?
The IUPAC name of 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol (CID 71402924) is 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol.
What is the SMILES notation for 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol?
The canonical SMILES for 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol is CCN(CC(C)O)c1cccnn1.
What is the InChIKey of 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol?
The InChIKey is DVMNMKPINBGDIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-3-12(7-8(2)13)9-5-4-6-10-11-9/h4-6,8,13H,3,7H2,1-2H3.
What are the key properties of 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol?
1-[ethyl(pyridazin-3-yl)amino]propan-2-ol has a molecular weight of 181.24 g/mol, XLogP of 0.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(pyridazin-3-yl)amino]propan-2-ol is sourced from PubChem (CID 71402924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).